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  1. ALA2004771

    Name:
    SID103904651

    Mol. Formula:
    C21H15N3O2

    M.W.:
    341.37

    Type:
    Small molecule

    AlogP:
    4.48

    Polar Surface Area:
    67.16

    HBA:
    4

    HBD:
    2

    #RO5 Violations:
    ---

    #Rotatable Bonds:
    3

    Passes Ro3:
    N

    QED Weighted:
    0.58

    DETAILS
  2. ALA2000894

    Name:
    SID103905355

    Mol. Formula:
    C22H18N4O3

    M.W.:
    386.41

    Type:
    Small molecule

    AlogP:
    2.67

    Polar Surface Area:
    110.24

    HBA:
    6

    HBD:
    3

    #RO5 Violations:
    ---

    #Rotatable Bonds:
    3

    Passes Ro3:
    N

    QED Weighted:
    0.28

    DETAILS
  3. ALA1999126

    Name:
    SID103905301

    Mol. Formula:
    C24H17N5O2

    M.W.:
    407.43

    Type:
    Small molecule

    AlogP:
    4.18

    Polar Surface Area:
    93.99

    HBA:
    6

    HBD:
    1

    #RO5 Violations:
    ---

    #Rotatable Bonds:
    2

    Passes Ro3:
    N

    QED Weighted:
    0.50

    DETAILS
  4. ALA1997839

    Name:
    SID103905357

    Mol. Formula:
    C25H21NO4

    M.W.:
    399.45

    Type:
    Small molecule

    AlogP:
    4.85

    Polar Surface Area:
    68.53

    HBA:
    5

    HBD:
    1

    #RO5 Violations:
    ---

    #Rotatable Bonds:
    4

    Passes Ro3:
    N

    QED Weighted:
    0.50

    DETAILS
  5. ALA1997503

    Name:
    SID103904948

    Mol. Formula:
    C23H24ClN3O4

    M.W.:
    441.92

    Type:
    Small molecule

    AlogP:
    5.51

    Polar Surface Area:
    97.48

    HBA:
    6

    HBD:
    2

    #RO5 Violations:
    1

    #Rotatable Bonds:
    7

    Passes Ro3:
    N

    QED Weighted:
    0.50

    DETAILS
  6. ALA1994214

    Name:
    SID103905609

    Mol. Formula:
    C21H27F3N4

    M.W.:
    392.47

    Type:
    Small molecule

    AlogP:
    5.66

    Polar Surface Area:
    49.84

    HBA:
    4

    HBD:
    2

    #RO5 Violations:
    1

    #Rotatable Bonds:
    7

    Passes Ro3:
    N

    QED Weighted:
    0.64

    DETAILS
  7. ALA1992922

    Name:
    SID103904209

    Mol. Formula:
    C15H16N4O2

    M.W.:
    284.32

    Type:
    Small molecule

    AlogP:
    1.39

    Polar Surface Area:
    94.06

    HBA:
    5

    HBD:
    4

    #RO5 Violations:
    ---

    #Rotatable Bonds:
    5

    Passes Ro3:
    N

    QED Weighted:
    0.57

    DETAILS
  8. ALA1991356

    Name:
    SID103904914

    Mol. Formula:
    C18H14N2O2

    M.W.:
    290.32

    Type:
    Small molecule

    AlogP:
    3.46

    Polar Surface Area:
    46.50

    HBA:
    3

    HBD:
    1

    #RO5 Violations:
    ---

    #Rotatable Bonds:
    2

    Passes Ro3:
    N

    QED Weighted:
    0.61

    DETAILS
  9. ALA1990821

    Name:
    SID103905170

    Mol. Formula:
    C28H29NO3

    M.W.:
    427.54

    Type:
    Small molecule

    AlogP:
    6.78

    Polar Surface Area:
    62.32

    HBA:
    2

    HBD:
    2

    #RO5 Violations:
    1

    #Rotatable Bonds:
    7

    Passes Ro3:
    N

    QED Weighted:
    0.32

    DETAILS
  10. ALA1987533

    Name:
    SID103904661

    Mol. Formula:
    C15H12ClN3O

    M.W.:
    285.73

    Type:
    Small molecule

    AlogP:
    3.40

    Polar Surface Area:
    57.78

    HBA:
    2

    HBD:
    2

    #RO5 Violations:
    ---

    #Rotatable Bonds:
    3

    Passes Ro3:
    N

    QED Weighted:
    0.77

    DETAILS
  11. ALA1985690

    Name:
    SID103905537

    Mol. Formula:
    C27H32N4O3S2

    M.W.:
    524.71

    Type:
    Small molecule

    AlogP:
    6.61

    Polar Surface Area:
    107.20

    HBA:
    7

    HBD:
    2

    #RO5 Violations:
    2

    #Rotatable Bonds:
    10

    Passes Ro3:
    N

    QED Weighted:
    0.23

    DETAILS
  12. ALA1983309

    Name:
    SID103905006

    Mol. Formula:
    C16H13ClN2O3S

    M.W.:
    348.81

    Type:
    Small molecule

    AlogP:
    4.22

    Polar Surface Area:
    60.45

    HBA:
    5

    HBD:
    1

    #RO5 Violations:
    ---

    #Rotatable Bonds:
    4

    Passes Ro3:
    N

    QED Weighted:
    0.77

    DETAILS
  13. ALA1983255

    Name:
    SID103905633

    Mol. Formula:
    C20H24N4O

    M.W.:
    336.44

    Type:
    Small molecule

    AlogP:
    3.76

    Polar Surface Area:
    87.05

    HBA:
    5

    HBD:
    2

    #RO5 Violations:
    ---

    #Rotatable Bonds:
    7

    Passes Ro3:
    N

    QED Weighted:
    0.64

    DETAILS
  14. ALA1982135

    Name:
    SID103904356

    Mol. Formula:
    C22H19N5OS

    M.W.:
    401.50

    Type:
    Small molecule

    AlogP:
    4.99

    Polar Surface Area:
    92.93

    HBA:
    5

    HBD:
    3

    #RO5 Violations:
    ---

    #Rotatable Bonds:
    2

    Passes Ro3:
    N

    QED Weighted:
    0.44

    DETAILS
  15. ALA1976396

    Name:
    SID103905174

    Mol. Formula:
    C36H39N3O6

    M.W.:
    609.72

    Type:
    Small molecule

    AlogP:
    5.73

    Polar Surface Area:
    135.90

    HBA:
    6

    HBD:
    4

    #RO5 Violations:
    2

    #Rotatable Bonds:
    16

    Passes Ro3:
    N

    QED Weighted:
    0.10

    DETAILS
  16. ALA1975208

    Name:
    SID103905290

    Mol. Formula:
    C16H17FN4O4

    M.W.:
    348.33

    Type:
    Small molecule

    AlogP:
    0.78

    Polar Surface Area:
    115.39

    HBA:
    5

    HBD:
    3

    #RO5 Violations:
    ---

    #Rotatable Bonds:
    3

    Passes Ro3:
    N

    QED Weighted:
    0.76

    DETAILS
  17. ALA1970709

    Name:
    SID103904666

    Mol. Formula:
    C15H13BrN4O

    M.W.:
    345.20

    Type:
    Small molecule

    AlogP:
    3.65

    Polar Surface Area:
    69.81

    HBA:
    2

    HBD:
    3

    #RO5 Violations:
    ---

    #Rotatable Bonds:
    3

    Passes Ro3:
    N

    QED Weighted:
    0.68

    DETAILS
  18. ALA1967116

    Name:
    SID103904313

    Mol. Formula:
    C25H22N6OS

    M.W.:
    454.56

    Type:
    Small molecule

    AlogP:
    5.90

    Polar Surface Area:
    97.86

    HBA:
    6

    HBD:
    3

    #RO5 Violations:
    1

    #Rotatable Bonds:
    4

    Passes Ro3:
    N

    QED Weighted:
    0.31

    DETAILS
  19. ALA1964777

    Name:
    SID103905045

    Mol. Formula:
    C14H9FN2O2S

    M.W.:
    288.30

    Type:
    Small molecule

    AlogP:
    3.33

    Polar Surface Area:
    65.21

    HBA:
    4

    HBD:
    1

    #RO5 Violations:
    ---

    #Rotatable Bonds:
    3

    Passes Ro3:
    N

    QED Weighted:
    0.80

    DETAILS
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